3-(4-acetylphenyl)-5-(propan-2-yl)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one
TL;DR: 3-(4-acetylphenyl)-5-(propan-2-yl)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one (CAS 1008688-57-0) is a chemical compound with molecular formula C14H16N2O2S and molecular weight 276.09326 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-acetylphenyl)-5-propan-2-yl-2-sulfanylideneimidazolidin-4-one
Also Known As: SDCCGMLS-0065254.P001, BAS 07128409, 1-(4-acetylphenyl)-4-isopropyl-2-mercapto-1H-imidazol-5(4H)-one, 3-(4-acetylphenyl)-5-propan-2-yl-2-sulfanylideneimidazolidin-4-one, 3-(4-Acetyl-phenyl)-5-isopropyl-2-mercapto-3,5-dihydro-imidazol-4-one
Technical Specifications
| Molecular Formula | C14H16N2O2S |
| Molecular Weight | 276.09326 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 81.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 276.09326 Da |
| Heavy Atoms | 19 |
| Complexity | 400.0 |
| SMILES | CC(C)C1C(=O)N(C(=S)N1)C2=CC=C(C=C2)C(=O)C |
| InChIKey | MXCUWFWRXYCAEO-UHFFFAOYSA-N |
Chemical Property Profile of 3-(4-acetylphenyl)-5-(propan-2-yl)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one
Property Insights of 3-(4-acetylphenyl)-5-(propan-2-yl)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-acetylphenyl)-5-(propan-2-yl)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one. The TPSA of 81.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-acetylphenyl)-5-(propan-2-yl)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one. Following Lipinski's Rule of Five, 3-(4-acetylphenyl)-5-(propan-2-yl)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(4-acetylphenyl)-5-(propan-2-yl)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one?
The CAS number of 3-(4-acetylphenyl)-5-(propan-2-yl)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one is 1008688-57-0.
What is the molecular formula of 3-(4-acetylphenyl)-5-(propan-2-yl)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one?
The molecular formula of 3-(4-acetylphenyl)-5-(propan-2-yl)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one is C14H16N2O2S.
What is the molecular weight of 3-(4-acetylphenyl)-5-(propan-2-yl)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one?
The molecular weight of 3-(4-acetylphenyl)-5-(propan-2-yl)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one is 276.09326 g/mol.
Where can I buy 3-(4-acetylphenyl)-5-(propan-2-yl)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one?
You can request a quote for 3-(4-acetylphenyl)-5-(propan-2-yl)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(4-acetylphenyl)-5-(propan-2-yl)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one?
Yes, CoreyChem provides custom synthesis services for 3-(4-acetylphenyl)-5-(propan-2-yl)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.